5-bromanyl-N2-[4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-N4-phenyl-pyrimidine-2,4-diamine

Systemtic Name: 5-bromanyl-N2-[4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-N4-phenyl-pyrimidine-2,4-diamine Openeye Name: 5-bromo-N2-[4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-N4-phenyl-pyrimidine-2,4-diamine CAS Name: 5-bromo-N2-[4-[3-(4-methyl-1-piperazinyl)propoxy]phenyl]-N4-phenylpyrimidine-2,4-diamine IUPAC Name: 5-bromo-2-N-[4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-4-N-phenylpyrimidine-2,4-diamine Traditional Name: (4-anilino-5-bromo-pyrimidin-2-yl)-[4-[3-(4-methylpiperazino)propoxy]phenyl]amine Formula: C24H29BrN6O MolecularWeight: 497.43066

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCOC2=CC=C(C=C2)NC3=NC=C(C(=N3)NC4=CC=CC=C4)Br

Isomeric SMILES

CN1CCN(CC1)CCCOC2=CC=C(C=C2)NC3=NC=C(C(=N3)NC4=CC=CC=C4)Br

InChI

InChI=1S/C24H29BrN6O/c1-30-13-15-31(16-14-30)12-5-17-32-21-10-8-20(9-11-21)28-24-26-18-22(25)23(29-24)27-19-6-3-2-4-7-19/h2-4,6-11,18H,5,12-17H2,1H3,(H2,26,27,28,29)